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2060028-34-2 | 2-(aminomethyl)-2,3-dihydro-1-benzofuran-5-carbaldehyde
CAS No: 2060028-34-2 Catalog No: AG01BPPE MDL No:MFCD30500480
Product Description
Catalog Number:
AG01BPPE
Chemical Name:
2-(aminomethyl)-2,3-dihydro-1-benzofuran-5-carbaldehyde
CAS Number:
2060028-34-2
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD30500480
IUPAC Name:
2-(aminomethyl)-2,3-dihydro-1-benzofuran-5-carbaldehyde
InChI:
InChI=1S/C10H11NO2/c11-5-9-4-8-3-7(6-12)1-2-10(8)13-9/h1-3,6,9H,4-5,11H2
InChI Key:
TUFXGCURFTYFQB-UHFFFAOYSA-N
SMILES:
NCC1Oc2c(C1)cc(cc2)C=O
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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